(E)-3-(4-dimethylaminophenyl)-1-[4-(6-pyridin-2-ylpyridin-3-yl)carbonylpiperazin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(4-dimethylaminophenyl)-1-[4-(6-pyridin-2-ylpyridin-3-yl)carbonylpiperazin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(4-dimethylaminophenyl)-1-[4-[6-(2-pyridyl)pyridine-3-carbonyl]piperazin-1-yl]prop-2-en-1-one CAS Name: (E)-3-(4-dimethylaminophenyl)-1-[4-[oxo-[6-(2-pyridinyl)-3-pyridinyl]methyl]-1-piperazinyl]-2-propen-1-one IUPAC Name: (E)-3-(4-dimethylaminophenyl)-1-[4-(6-pyridin-2-ylpyridine-3-carbonyl)piperazin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(4-dimethylaminophenyl)-1-[4-[6-(2-pyridyl)nicotinoyl]piperazino]prop-2-en-1-one Formula: C26H27N5O2 MolecularWeight: 441.52488

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C=CC(=O)N2CCN(CC2)C(=O)C3=CN=C(C=C3)C4=CC=CC=N4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)/C=C/C(=O)N2CCN(CC2)C(=O)C3=CN=C(C=C3)C4=CC=CC=N4

InChI

InChI=1S/C26H27N5O2/c1-29(2)22-10-6-20(7-11-22)8-13-25(32)30-15-17-31(18-16-30)26(33)21-9-12-24(28-19-21)23-5-3-4-14-27-23/h3-14,19H,15-18H2,1-2H3/b13-8+